General Information of the Compound
| Compound ID |
CP0159814
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-[1-[4-(4-methylphenyl)-4-oxobutyl]piperidin-4-yl]phenyl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H30N2O2
|
||||||||||||||||||
| Molecular Weight |
378.516
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(C)cc2)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H30N2O2/c1-18-8-10-21(11-9-18)24(28)7-4-14-26-15-12-20(13-16-26)22-5-3-6-23(17-22)25-19(2)27/h3,5-6,8-11,17,20H,4,7,12-16H2,1-2H3,(H,25,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
MRSTZRHYYBFJBO-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound